| Site | Residue | pLDDT | pLDDT confidence | pLDDT10 | pLDDT10 confidence | SASA | SASA [Ų] | SASA10 | SASA10 [Ų] | RSA | RSA unformatted | RSA10 | RSA10 unformatted | Surface | Surface10 (not used) | Disorder (not used) | Disorder | Sec. str. | Secondary structure | Isomer | Phi (φ) | Psi (ψ) | Omega (ω) | Chi 1 (χ1) | Chi 2 (χ2) | Chi 3 (χ3) | Chi 4 (χ4) | Chi 5 (χ5) | Tau (τ) | Contacts (colored by PAE) | Contact details |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1 | M | 82 | Confident | 95.3 | Very high | 214 Ų | 214 | 121.5 Ų | 121.5 | 100% | 1.054 | 58% | 0.575 | S | S | * | * | 0 | -51.3 | 0 | -95.7 | -172.8 | -78.8 | 0 | 0 | 113.1 | S3 R4 L5 | M1-S3 PolarHBondContact O-N 2.84Å; M1-R4 PolarHBondContact O-N 3.09Å; M1-R4 VanDerWaalsContact O-N 3.16Å; M1-L5 PolarHBondContact O-N 3.46Å; M1-L5 VanDerWaalsContact O-N 3.13Å | |||
| 2 | L | 91.2 | Very high | 95.5 | Very high | 119 Ų | 119 | 121.3 Ų | 121.3 | 62% | 0.623 | 57% | 0.574 | S | S | * | * | H | α-helix | trans | -55.5 | -43.6 | -176.8 | -172.7 | 64.7 | 0 | 0 | 0 | 113.9 | R4 L5 Q6 | L2-R4 PolarHBondContact O-N 2.97Å; L2-L5 PolarHBondContact O-N 2.78Å; L2-Q6 WeakPolarHBondContact O-CG 3.3Å; L2-Q6 PolarHBondContact O-N 2.85Å |
| 3 | S | 95.3 | Very high | 95.7 | Very high | 76 Ų | 76 | 119.5 Ų | 119.5 | 53% | 0.531 | 57% | 0.565 | S | S | . | * | H | α-helix | trans | -60 | -44.4 | 177.7 | -41.5 | 0 | 0 | 0 | 0 | 112.4 | M1 L5 Q6 E7 | M1-S3 PolarHBondContact O-N 2.84Å; S3-L5 VanDerWaalsContact C-N 3.29Å; S3-L5 PolarHBondContact O-N 2.96Å; S3-Q6 WeakPolarHBondContact O-CB 3.19Å; S3-Q6 PolarHBondContact O-N 3.12Å; S3-Q6 VanDerWaalsContact O-N 3.14Å; S3-E7 WeakPolarHBondContact O-CG 3.43Å; S3-E7 PolarHBondContact O-N 3.48Å |
| 4 | R | 96.1 | Very high | 95.9 | Very high | 150 Ų | 150 | 115.7 Ų | 115.7 | 57% | 0.566 | 55% | 0.553 | S | S | * | * | H | α-helix | trans | -61.9 | -38.3 | 177.3 | -177.3 | 57.5 | 175 | -167.8 | 2.4 | 112 | M1 L2 E7 L8 | M1-R4 PolarHBondContact O-N 3.09Å; M1-R4 VanDerWaalsContact O-N 3.16Å; L2-R4 PolarHBondContact O-N 2.97Å; R4-E7 IonicContact NH1-OE2 3.74Å; R4-E7 PolarHBondContact O-N 3.41Å; R4-L8 HydrophobicContact CG-CD1 4.32Å; R4-L8 WeakPolarHBondContact O-CG 3.5Å; R4-L8 PolarHBondContact O-N 3.28Å |
| 5 | L | 97.4 | Very high | 96.1 | Very high | 96 Ų | 96 | 114.8 Ų | 114.8 | 50% | 0.503 | 55% | 0.552 | S | S | . | * | H | α-helix | trans | -70 | -33.8 | 177.2 | -168.5 | 135.1 | 0 | 0 | 0 | 112 | M1 L2 S3 R9 | M1-L5 PolarHBondContact O-N 3.46Å; M1-L5 VanDerWaalsContact O-N 3.13Å; L2-L5 PolarHBondContact O-N 2.78Å; S3-L5 VanDerWaalsContact C-N 3.29Å; S3-L5 PolarHBondContact O-N 2.96Å; L5-R9 WeakPolarHBondContact O-CB 3.27Å; L5-R9 PolarHBondContact O-N 3.46Å; L5-R9 VanDerWaalsContact O-N 3.12Å |
| 6 | Q | 97.6 | Very high | 96.3 | Very high | 98 Ų | 98 | 114.1 Ų | 114.1 | 46% | 0.458 | 55% | 0.551 | S | S | . | * | H | α-helix | trans | -69.3 | -40 | 172.8 | -70.9 | 174 | -23.2 | 0 | 0 | 112.2 | L2 S3 R9 K10 | L2-Q6 WeakPolarHBondContact O-CG 3.3Å; L2-Q6 PolarHBondContact O-N 2.85Å; S3-Q6 WeakPolarHBondContact O-CB 3.19Å; S3-Q6 PolarHBondContact O-N 3.12Å; S3-Q6 VanDerWaalsContact O-N 3.14Å; Q6-R9 PolarHBondContact O-N 2.77Å; Q6-K10 WeakPolarHBondContact O-CG 3.41Å; Q6-K10 PolarHBondContact O-N 3.43Å; Q6-K10 VanDerWaalsContact O-N 3.1Å |
| 7 | E | 97.4 | Very high | 96.4 | Very high | 101 Ų | 101 | 116.4 Ų | 116.4 | 47% | 0.472 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -59.7 | -51.6 | 173.2 | -73.6 | 163.2 | -158.1 | 0 | 0 | 111.2 | S3 R4 R9 K10 E11 | S3-E7 WeakPolarHBondContact O-CG 3.43Å; S3-E7 PolarHBondContact O-N 3.48Å; R4-E7 IonicContact NH1-OE2 3.74Å; R4-E7 PolarHBondContact O-N 3.41Å; E7-R9 VanDerWaalsContact C-N 3.27Å; E7-R9 PolarHBondContact O-N 3.29Å; E7-K10 WeakPolarHBondContact O-CB 3.46Å; E7-K10 PolarHBondContact O-N 3.2Å; E7-K10 VanDerWaalsContact O-N 3.09Å; E7-E11 PolarHBondContact O-N 3.47Å |
| 8 | L | 98.1 | Very high | 96.5 | Very high | 85 Ų | 85 | 115.8 Ų | 115.8 | 45% | 0.445 | 55% | 0.553 | S | S | . | * | H | α-helix | trans | -58.8 | -38.4 | 178.9 | -73.7 | 171.4 | 0 | 0 | 0 | 112.3 | R4 E11 E12 | R4-L8 HydrophobicContact CG-CD1 4.32Å; R4-L8 WeakPolarHBondContact O-CG 3.5Å; R4-L8 PolarHBondContact O-N 3.28Å; L8-E11 PolarHBondContact O-N 3.28Å; L8-E12 WeakPolarHBondContact O-CB 3.21Å; L8-E12 PolarHBondContact O-N 2.89Å |
| 9 | R | 97.2 | Very high | 96.7 | Very high | 152 Ų | 152 | 117.5 Ų | 117.5 | 57% | 0.574 | 56% | 0.558 | S | S | * | * | H | α-helix | trans | -64.7 | -42 | 175.8 | -170.2 | -171.2 | -53.4 | 173.7 | 2 | 112.3 | L5 Q6 E7 E11 E13 | L5-R9 WeakPolarHBondContact O-CB 3.27Å; L5-R9 PolarHBondContact O-N 3.46Å; L5-R9 VanDerWaalsContact O-N 3.12Å; Q6-R9 PolarHBondContact O-N 2.77Å; E7-R9 VanDerWaalsContact C-N 3.27Å; E7-R9 PolarHBondContact O-N 3.29Å; R9-E11 VanDerWaalsContact C-N 3.35Å; R9-E13 WeakPolarHBondContact O-CB 3.46Å; R9-E13 PolarHBondContact O-N 3.16Å |
| 10 | K | 97.7 | Very high | 96.8 | Very high | 143 Ų | 143 | 114.3 Ų | 114.3 | 62% | 0.622 | 55% | 0.552 | S | S | * | * | H | α-helix | trans | -65 | -42.7 | 176.2 | -72 | 175.9 | 179.7 | -179.4 | 0 | 110.7 | Q6 E7 E13 T14 | Q6-K10 WeakPolarHBondContact O-CG 3.41Å; Q6-K10 PolarHBondContact O-N 3.43Å; Q6-K10 VanDerWaalsContact O-N 3.1Å; E7-K10 WeakPolarHBondContact O-CB 3.46Å; E7-K10 PolarHBondContact O-N 3.2Å; E7-K10 VanDerWaalsContact O-N 3.09Å; K10-E13 PolarHBondContact O-N 3.24Å; K10-T14 WeakPolarHBondContact O-CG2 3.42Å; K10-T14 PolarHBondContact O-N 3.23Å; K10-T14 PolarHBondContact O-OG1 3.04Å |
| 11 | E | 98 | Very high | 96.8 | Very high | 103 Ų | 103 | 111.3 Ų | 111.3 | 48% | 0.481 | 55% | 0.546 | S | S | . | . | H | α-helix | trans | -62.3 | -47.2 | 177.6 | -171.3 | 173.7 | -175.2 | 0 | 0 | 111.3 | E7 L8 R9 E13 T14 L15 | E7-E11 PolarHBondContact O-N 3.47Å; L8-E11 PolarHBondContact O-N 3.28Å; R9-E11 VanDerWaalsContact C-N 3.35Å; E11-E13 VanDerWaalsContact C-N 3.33Å; E11-E13 PolarHBondContact O-N 3.42Å; E11-T14 WeakPolarHBondContact CA-OG1 3.4Å; E11-T14 PolarHBondContact O-N 3.07Å; E11-T14 VanDerWaalsContact O-N 3.15Å; E11-T14 PolarHBondContact O-OG1 3.5Å; E11-L15 HydrophobicContact CG-CD1 4.27Å; E11-L15 WeakPolarHBondContact O-CG 3.33Å; E11-L15 PolarHBondContact O-N 2.79Å |
| 12 | E | 98.3 | Very high | 97.6 | Very high | 119 Ų | 119 | 106.3 Ų | 106.3 | 56% | 0.556 | 52% | 0.523 | S | S | * | . | H | α-helix | trans | -55.6 | -46.6 | 174 | -178.1 | -177.9 | -165.2 | 0 | 0 | 111.7 | L8 T14 L15 L16 | L8-E12 WeakPolarHBondContact O-CB 3.21Å; L8-E12 PolarHBondContact O-N 2.89Å; E12-T14 VanDerWaalsContact C-N 3.35Å; E12-T14 PolarHBondContact O-N 3.45Å; E12-L15 PolarHBondContact O-N 3.33Å; E12-L16 HydrophobicContact CG-CD1 4.37Å; E12-L16 WeakPolarHBondContact O-CG 3.38Å; E12-L16 PolarHBondContact O-N 2.89Å |
| 13 | E | 98.3 | Very high | 98 | Very high | 98 Ų | 98 | 105.7 Ų | 105.7 | 46% | 0.458 | 52% | 0.517 | S | S | . | . | H | α-helix | trans | -60.6 | -44 | 177 | -172.9 | -177.8 | 178.3 | 0 | 0 | 111.7 | R9 K10 E11 L16 R17 | R9-E13 WeakPolarHBondContact O-CB 3.46Å; R9-E13 PolarHBondContact O-N 3.16Å; K10-E13 PolarHBondContact O-N 3.24Å; E11-E13 VanDerWaalsContact C-N 3.33Å; E11-E13 PolarHBondContact O-N 3.42Å; E13-L16 PolarHBondContact O-N 2.96Å; E13-R17 VanDerWaalsContact CD-NH2 3.33Å; E13-R17 WeakPolarHBondContact O-CG 3.38Å; E13-R17 PolarHBondContact O-N 2.89Å; E13-R17 VanDerWaalsContact O-N 3.12Å; E13-R17 IonicContact OE1-CZ 2.78Å; E13-R17 IonicContact OE1-NE 3.99Å; E13-R17 IonicContact OE1-NH2 3.58Å; E13-R17 PolarHBondContact OE1-NH2 2.74Å; E13-R17 IonicContact OE2-NH2 2.65Å |
| 14 | T | 98.5 | Very high | 98.2 | Very high | 66 Ų | 66 | 107.2 Ų | 107.2 | 41% | 0.405 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.8 | -41.6 | 176.4 | 59.3 | 0 | 0 | 0 | 0 | 111.9 | K10 E11 E12 L16 R17 L18 | K10-T14 WeakPolarHBondContact O-CG2 3.42Å; K10-T14 PolarHBondContact O-N 3.23Å; K10-T14 PolarHBondContact O-OG1 3.04Å; E11-T14 WeakPolarHBondContact CA-OG1 3.4Å; E11-T14 PolarHBondContact O-N 3.07Å; E11-T14 VanDerWaalsContact O-N 3.15Å; E11-T14 PolarHBondContact O-OG1 3.5Å; E12-T14 VanDerWaalsContact C-N 3.35Å; E12-T14 PolarHBondContact O-N 3.45Å; T14-L16 VanDerWaalsContact C-N 3.33Å; T14-L16 PolarHBondContact O-N 2.91Å; T14-R17 PolarHBondContact O-N 3.17Å; T14-L18 WeakPolarHBondContact O-CD1 3.32Å; T14-L18 PolarHBondContact O-N 3.31Å |
| 15 | L | 98.8 | Very high | 98.3 | Very high | 102 Ų | 102 | 106 Ų | 106 | 53% | 0.534 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63.1 | -39.7 | 177.5 | -75.2 | 171.1 | 0 | 0 | 0 | 111.8 | E11 E12 L18 K19 | E11-L15 HydrophobicContact CG-CD1 4.27Å; E11-L15 WeakPolarHBondContact O-CG 3.33Å; E11-L15 PolarHBondContact O-N 2.79Å; E12-L15 PolarHBondContact O-N 3.33Å; L15-L18 PolarHBondContact O-N 3.37Å; L15-K19 VanDerWaalsContact O-CB 3.26Å; L15-K19 WeakPolarHBondContact O-CB 3.49Å; L15-K19 PolarHBondContact O-N 3.46Å |
| 16 | L | 98.7 | Very high | 98.4 | Very high | 103 Ų | 103 | 106.7 Ų | 106.7 | 54% | 0.539 | 52% | 0.523 | S | S | . | . | H | α-helix | trans | -62.7 | -42.2 | 175.1 | -74.1 | 172.6 | 0 | 0 | 0 | 111.8 | E12 E13 T14 K19 A20 | E12-L16 HydrophobicContact CG-CD1 4.37Å; E12-L16 WeakPolarHBondContact O-CG 3.38Å; E12-L16 PolarHBondContact O-N 2.89Å; E13-L16 PolarHBondContact O-N 2.96Å; T14-L16 VanDerWaalsContact C-N 3.33Å; T14-L16 PolarHBondContact O-N 2.91Å; L16-K19 PolarHBondContact O-N 3.34Å; L16-A20 PolarHBondContact O-N 3.46Å |
| 17 | R | 98.6 | Very high | 98.4 | Very high | 154 Ų | 154 | 105.3 Ų | 105.3 | 58% | 0.581 | 52% | 0.519 | S | S | * | . | H | α-helix | trans | -64.2 | -44.6 | 175 | -65.8 | 179 | -159.9 | 178.4 | 3.5 | 111.9 | E13 T14 A20 A21 | E13-R17 VanDerWaalsContact CD-NH2 3.33Å; E13-R17 WeakPolarHBondContact O-CG 3.38Å; E13-R17 PolarHBondContact O-N 2.89Å; E13-R17 VanDerWaalsContact O-N 3.12Å; E13-R17 IonicContact OE1-CZ 2.78Å; E13-R17 IonicContact OE1-NE 3.99Å; E13-R17 IonicContact OE1-NH2 3.58Å; E13-R17 PolarHBondContact OE1-NH2 2.74Å; E13-R17 IonicContact OE2-NH2 2.65Å; T14-R17 PolarHBondContact O-N 3.17Å; R17-A20 PolarHBondContact O-N 2.77Å; R17-A21 PolarHBondContact O-N 3.34Å |
| 18 | L | 98.7 | Very high | 98.5 | Very high | 105 Ų | 105 | 108.6 Ų | 108.6 | 55% | 0.55 | 53% | 0.527 | S | S | . | . | H | α-helix | trans | -62.8 | -43.2 | 177.3 | -93.6 | 74.1 | 0 | 0 | 0 | 111.3 | T14 L15 A20 A21 L22 | T14-L18 WeakPolarHBondContact O-CD1 3.32Å; T14-L18 PolarHBondContact O-N 3.31Å; L15-L18 PolarHBondContact O-N 3.37Å; L18-A20 VanDerWaalsContact C-N 3.33Å; L18-A20 PolarHBondContact O-N 3.24Å; L18-A21 PolarHBondContact O-N 3.31Å; L18-L22 WeakPolarHBondContact O-CB 3.33Å; L18-L22 WeakPolarHBondContact O-CG 3.36Å; L18-L22 PolarHBondContact O-N 3.35Å |
| 19 | K | 98.6 | Very high | 98.5 | Very high | 149 Ų | 149 | 109.7 Ų | 109.7 | 65% | 0.648 | 53% | 0.532 | S | S | * | . | H | α-helix | trans | -59.2 | -44.6 | 176.5 | -178.7 | -178 | 177.5 | -177.2 | 0 | 111.5 | L15 L16 L22 H23 | L15-K19 VanDerWaalsContact O-CB 3.26Å; L15-K19 WeakPolarHBondContact O-CB 3.49Å; L15-K19 PolarHBondContact O-N 3.46Å; L16-K19 PolarHBondContact O-N 3.34Å; K19-L22 PolarHBondContact O-N 3.45Å; K19-H23 WeakPolarHBondContact O-CB 3.45Å; K19-H23 PolarHBondContact O-N 3.17Å |
| 20 | A | 98.7 | Very high | 98.6 | Very high | 53 Ų | 53 | 108.5 Ų | 108.5 | 44% | 0.438 | 53% | 0.532 | S | S | . | . | H | α-helix | trans | -62.5 | -47.9 | 176.6 | 0 | 0 | 0 | 0 | 0 | 111.4 | L16 R17 L18 L22 H23 D24 | L16-A20 PolarHBondContact O-N 3.46Å; R17-A20 PolarHBondContact O-N 2.77Å; L18-A20 VanDerWaalsContact C-N 3.33Å; L18-A20 PolarHBondContact O-N 3.24Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.95Å; A20-H23 PolarHBondContact O-N 3.48Å; A20-D24 PolarHBondContact O-N 3.05Å |
| 21 | A | 98.6 | Very high | 98.6 | Very high | 51 Ų | 51 | 106.5 Ų | 106.5 | 42% | 0.421 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.2 | -41.6 | 178.3 | 0 | 0 | 0 | 0 | 0 | 112.8 | R17 L18 D24 Q25 | R17-A21 PolarHBondContact O-N 3.34Å; L18-A21 PolarHBondContact O-N 3.31Å; A21-D24 PolarHBondContact O-N 2.96Å; A21-Q25 WeakPolarHBondContact O-CG 3.33Å; A21-Q25 PolarHBondContact O-N 3.07Å |
| 22 | L | 98.8 | Very high | 98.6 | Very high | 109 Ų | 109 | 105.2 Ų | 105.2 | 57% | 0.571 | 53% | 0.525 | S | S | * | . | H | α-helix | trans | -66.3 | -40.1 | 176 | -75 | 169.5 | 0 | 0 | 0 | 112.2 | L18 K19 A20 Q25 L26 | L18-L22 WeakPolarHBondContact O-CB 3.33Å; L18-L22 WeakPolarHBondContact O-CG 3.36Å; L18-L22 PolarHBondContact O-N 3.35Å; K19-L22 PolarHBondContact O-N 3.45Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.95Å; L22-Q25 PolarHBondContact O-N 2.96Å; L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 PolarHBondContact O-N 3.45Å |
| 23 | H | 98.7 | Very high | 98.6 | Very high | 107 Ų | 107 | 104.7 Ų | 104.7 | 50% | 0.495 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.3 | -43 | 177 | -169.5 | 65.7 | 0 | 0 | 0 | 111.5 | K19 A20 L26 N27 | K19-H23 WeakPolarHBondContact O-CB 3.45Å; K19-H23 PolarHBondContact O-N 3.17Å; A20-H23 PolarHBondContact O-N 3.48Å; H23-L26 PolarHBondContact O-N 3.42Å; H23-N27 PolarHBondContact CD2-ND2 2.99Å; H23-N27 VanDerWaalsContact CD2-ND2 3.26Å; H23-N27 PolarHBondContact NE2-ND2 2.82Å; H23-N27 VanDerWaalsContact NE2-ND2 3.15Å; H23-N27 WeakPolarHBondContact O-CB 3.46Å; H23-N27 VanDerWaalsContact O-CG 3.26Å; H23-N27 PolarHBondContact O-N 3.01Å; H23-N27 PolarHBondContact O-ND2 3.29Å |
| 24 | D | 98.7 | Very high | 98.6 | Very high | 108 Ų | 108 | 104.1 Ų | 104.1 | 58% | 0.578 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -63.4 | -43.8 | 175.7 | -80.5 | 9.9 | 0 | 0 | 0 | 112.2 | A20 A21 L26 N27 R28 | A20-D24 PolarHBondContact O-N 3.05Å; A21-D24 PolarHBondContact O-N 2.96Å; D24-L26 VanDerWaalsContact C-N 3.35Å; D24-L26 PolarHBondContact O-N 3.42Å; D24-N27 PolarHBondContact O-N 3.41Å; D24-R28 WeakPolarHBondContact O-CB 3.33Å; D24-R28 PolarHBondContact O-N 3.15Å |
| 25 | Q | 98.8 | Very high | 98.6 | Very high | 123 Ų | 123 | 103.3 Ų | 103.3 | 58% | 0.575 | 52% | 0.522 | S | S | * | . | H | α-helix | trans | -61.1 | -43.1 | 176 | -76.5 | 179.8 | -15.9 | 0 | 0 | 112.1 | A21 L22 R28 L29 | A21-Q25 WeakPolarHBondContact O-CG 3.33Å; A21-Q25 PolarHBondContact O-N 3.07Å; L22-Q25 PolarHBondContact O-N 2.96Å; Q25-R28 PolarHBondContact O-N 3.24Å; Q25-L29 WeakPolarHBondContact O-CG 3.35Å; Q25-L29 PolarHBondContact O-N 3.41Å |
| 26 | L | 98.8 | Very high | 98.5 | Very high | 112 Ų | 112 | 103.1 Ų | 103.1 | 59% | 0.586 | 52% | 0.521 | S | S | * | . | H | α-helix | trans | -64.1 | -43 | 177.3 | -176.8 | 63.5 | 0 | 0 | 0 | 111.6 | L22 H23 D24 R28 L29 K30 | L22-L26 WeakPolarHBondContact O-CB 3.45Å; L22-L26 PolarHBondContact O-N 3.45Å; H23-L26 PolarHBondContact O-N 3.42Å; D24-L26 VanDerWaalsContact C-N 3.35Å; D24-L26 PolarHBondContact O-N 3.42Å; L26-R28 VanDerWaalsContact C-N 3.34Å; L26-R28 PolarHBondContact O-N 2.92Å; L26-L29 PolarHBondContact O-N 3.33Å; L26-K30 WeakPolarHBondContact O-CB 3.39Å; L26-K30 PolarHBondContact O-N 2.86Å |
| 27 | N | 98.6 | Very high | 98.5 | Very high | 68 Ų | 68 | 103.2 Ų | 103.2 | 36% | 0.364 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -62 | -43.1 | 176.8 | -73.6 | -28.2 | 0 | 0 | 0 | 111.4 | H23 D24 K30 V31 | H23-N27 PolarHBondContact CD2-ND2 2.99Å; H23-N27 VanDerWaalsContact CD2-ND2 3.26Å; H23-N27 PolarHBondContact NE2-ND2 2.82Å; H23-N27 VanDerWaalsContact NE2-ND2 3.15Å; H23-N27 WeakPolarHBondContact O-CB 3.46Å; H23-N27 VanDerWaalsContact O-CG 3.26Å; H23-N27 PolarHBondContact O-N 3.01Å; H23-N27 PolarHBondContact O-ND2 3.29Å; D24-N27 PolarHBondContact O-N 3.41Å; N27-K30 PolarHBondContact O-N 2.83Å; N27-V31 WeakPolarHBondContact O-CG2 3.48Å; N27-V31 PolarHBondContact O-N 3.47Å; N27-V31 VanDerWaalsContact O-N 3.1Å |
| 28 | R | 98.6 | Very high | 98.3 | Very high | 171 Ų | 171 | 99.1 Ų | 99.1 | 65% | 0.645 | 51% | 0.514 | S | S | * | . | H | α-helix | trans | -60.2 | -49.9 | 175.3 | 179.7 | -178.6 | 166.1 | -148.6 | -11.6 | 111.8 | D24 Q25 L26 K30 V31 E32 | D24-R28 WeakPolarHBondContact O-CB 3.33Å; D24-R28 PolarHBondContact O-N 3.15Å; Q25-R28 PolarHBondContact O-N 3.24Å; L26-R28 VanDerWaalsContact C-N 3.34Å; L26-R28 PolarHBondContact O-N 2.92Å; R28-K30 VanDerWaalsContact C-N 3.29Å; R28-K30 PolarHBondContact O-N 3.03Å; R28-V31 PolarHBondContact O-N 2.95Å; R28-V31 VanDerWaalsContact O-N 3.15Å; R28-E32 IonicContact CZ-OE1 3.21Å; R28-E32 IonicContact NE-OE1 3.58Å; R28-E32 PolarHBondContact NE-OE1 2.84Å; R28-E32 IonicContact NH2-OE1 2.84Å; R28-E32 PolarHBondContact NH2-OE1 3.26Å; R28-E32 PolarHBondContact O-N 2.95Å |
| 29 | L | 98.7 | Very high | 98.1 | Very high | 107 Ų | 107 | 99.6 Ų | 99.6 | 56% | 0.56 | 52% | 0.515 | S | S | * | . | H | α-helix | trans | -59.7 | -40.1 | 179.1 | -77.4 | 170.3 | 0 | 0 | 0 | 112.1 | Q25 L26 V31 E32 E33 | Q25-L29 WeakPolarHBondContact O-CG 3.35Å; Q25-L29 PolarHBondContact O-N 3.41Å; L26-L29 PolarHBondContact O-N 3.33Å; L29-V31 VanDerWaalsContact C-N 3.34Å; L29-V31 PolarHBondContact O-N 3.18Å; L29-E32 PolarHBondContact O-N 3.42Å; L29-E33 WeakPolarHBondContact O-CB 3.42Å; L29-E33 PolarHBondContact O-N 2.78Å |
| 30 | K | 98.7 | Very high | 97.9 | Very high | 128 Ų | 128 | 97.7 Ų | 97.7 | 56% | 0.557 | 51% | 0.511 | S | S | * | . | H | α-helix | trans | -62.2 | -40.8 | 176 | -176.4 | 177.1 | -180 | 179 | 0 | 112.4 | L26 N27 R28 E33 L34 | L26-K30 WeakPolarHBondContact O-CB 3.39Å; L26-K30 PolarHBondContact O-N 2.86Å; N27-K30 PolarHBondContact O-N 2.83Å; R28-K30 VanDerWaalsContact C-N 3.29Å; R28-K30 PolarHBondContact O-N 3.03Å; K30-E33 PolarHBondContact O-N 3.3Å; K30-L34 HydrophobicContact CG-CD1 4.4Å; K30-L34 WeakPolarHBondContact O-CG 3.41Å; K30-L34 PolarHBondContact O-N 3.48Å |
| 31 | V | 98.6 | Very high | 97.7 | Very high | 100 Ų | 100 | 98.6 Ų | 98.6 | 61% | 0.606 | 51% | 0.513 | S | S | * | . | H | α-helix | trans | -65.4 | -43.3 | 176.3 | 171.5 | 0 | 0 | 0 | 0 | 110.9 | N27 R28 L29 L34 A35 | N27-V31 WeakPolarHBondContact O-CG2 3.48Å; N27-V31 PolarHBondContact O-N 3.47Å; N27-V31 VanDerWaalsContact O-N 3.1Å; R28-V31 PolarHBondContact O-N 2.95Å; R28-V31 VanDerWaalsContact O-N 3.15Å; L29-V31 VanDerWaalsContact C-N 3.34Å; L29-V31 PolarHBondContact O-N 3.18Å; V31-L34 PolarHBondContact O-N 2.88Å; V31-A35 WeakPolarHBondContact O-CB 3.42Å; V31-A35 PolarHBondContact O-N 3.38Å |
| 32 | E | 98.4 | Very high | 97.2 | Very high | 77 Ų | 77 | 99.8 Ų | 99.8 | 36% | 0.36 | 52% | 0.519 | S | S | . | . | H | α-helix | trans | -63 | -41.4 | 176.8 | -70 | 177.2 | -170.1 | 0 | 0 | 111.8 | R28 L29 A35 L36 | R28-E32 IonicContact CZ-OE1 3.21Å; R28-E32 IonicContact NE-OE1 3.58Å; R28-E32 PolarHBondContact NE-OE1 2.84Å; R28-E32 IonicContact NH2-OE1 2.84Å; R28-E32 PolarHBondContact NH2-OE1 3.26Å; R28-E32 PolarHBondContact O-N 2.95Å; L29-E32 PolarHBondContact O-N 3.42Å; E32-A35 PolarHBondContact O-N 2.74Å; E32-L36 WeakPolarHBondContact O-CG 3.15Å; E32-L36 PolarHBondContact O-N 2.97Å |
| 33 | E | 98.2 | Very high | 96.7 | Very high | 107 Ų | 107 | 102.5 Ų | 102.5 | 50% | 0.5 | 52% | 0.522 | S | S | . | . | H | α-helix | trans | -63.1 | -46.1 | 176.6 | -174.3 | -106.8 | 158.7 | 0 | 0 | 112.2 | L29 K30 A35 L36 Q37 | L29-E33 WeakPolarHBondContact O-CB 3.42Å; L29-E33 PolarHBondContact O-N 2.78Å; K30-E33 PolarHBondContact O-N 3.3Å; E33-A35 VanDerWaalsContact C-N 3.32Å; E33-A35 PolarHBondContact O-N 2.98Å; E33-L36 PolarHBondContact O-N 3.02Å; E33-Q37 WeakPolarHBondContact O-CB 3.35Å; E33-Q37 PolarHBondContact O-N 3.37Å |
| 34 | L | 98.2 | Very high | 95.8 | Very high | 86 Ų | 86 | 106.1 Ų | 106.1 | 45% | 0.45 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -62.5 | -38.2 | 174.8 | -71.6 | 172.9 | 0 | 0 | 0 | 112.3 | K30 V31 Q37 S38 | K30-L34 HydrophobicContact CG-CD1 4.4Å; K30-L34 WeakPolarHBondContact O-CG 3.41Å; K30-L34 PolarHBondContact O-N 3.48Å; V31-L34 PolarHBondContact O-N 2.88Å; L34-Q37 PolarHBondContact O-N 3.45Å; L34-S38 WeakPolarHBondContact O-CB 3.43Å; L34-S38 PolarHBondContact O-N 3.03Å |
| 35 | A | 97.6 | Very high | 94.3 | Very high | 49 Ų | 49 | 102.6 Ų | 102.6 | 41% | 0.405 | 52% | 0.52 | S | S | . | . | H | α-helix | trans | -64.1 | -44.6 | 175.7 | 0 | 0 | 0 | 0 | 0 | 111.4 | V31 E32 E33 S38 M39 | V31-A35 WeakPolarHBondContact O-CB 3.42Å; V31-A35 PolarHBondContact O-N 3.38Å; E32-A35 PolarHBondContact O-N 2.74Å; E33-A35 VanDerWaalsContact C-N 3.32Å; E33-A35 PolarHBondContact O-N 2.98Å; A35-S38 WeakPolarHBondContact O-CB 3.36Å; A35-S38 PolarHBondContact O-N 3.3Å; A35-M39 WeakPolarHBondContact O-CG 3.43Å; A35-M39 PolarHBondContact O-N 3.39Å |
| 36 | L | 98 | Very high | 92.6 | Very high | 99 Ų | 99 | 102 Ų | 102 | 52% | 0.518 | 52% | 0.521 | S | S | . | . | H | α-helix | trans | -63 | -45.7 | 175.4 | -71.1 | 164.3 | 0 | 0 | 0 | 111.7 | E32 E33 S38 M39 I40 | E32-L36 WeakPolarHBondContact O-CG 3.15Å; E32-L36 PolarHBondContact O-N 2.97Å; E33-L36 PolarHBondContact O-N 3.02Å; L36-S38 VanDerWaalsContact C-N 3.29Å; L36-S38 PolarHBondContact O-N 3.47Å; L36-M39 HydrophobicContact CB-CE 4.47Å; L36-M39 HydrophobicContact CD2-CE 3.55Å; L36-M39 HydrophobicContact CG-CE 4.17Å; L36-M39 PolarHBondContact O-N 3.15Å; L36-I40 WeakPolarHBondContact O-CG1 3.26Å; L36-I40 PolarHBondContact O-N 2.96Å |
| 37 | Q | 96.9 | Very high | 90.7 | Very high | 104 Ų | 104 | 102 Ų | 102 | 49% | 0.486 | 52% | 0.518 | S | S | . | . | H | α-helix | trans | -59.2 | -42.4 | 175.9 | -172.6 | -178.3 | 37.7 | 0 | 0 | 111.2 | E33 L34 I40 S41 | E33-Q37 WeakPolarHBondContact O-CB 3.35Å; E33-Q37 PolarHBondContact O-N 3.37Å; L34-Q37 PolarHBondContact O-N 3.45Å; Q37-I40 PolarHBondContact O-N 3.01Å; Q37-S41 VanDerWaalsContact O-CB 3.32Å; Q37-S41 WeakPolarHBondContact O-CB 3.42Å; Q37-S41 PolarHBondContact O-N 3.47Å; Q37-S41 PolarHBondContact O-OG 2.93Å |
| 38 | S | 95.6 | Very high | 88.8 | Confident | 69 Ų | 69 | 105 Ų | 105 | 48% | 0.483 | 53% | 0.531 | S | S | . | . | H | α-helix | trans | -60.8 | -47.5 | 174.8 | -172.3 | 0 | 0 | 0 | 0 | 111 | L34 A35 L36 I40 S41 S42 | L34-S38 WeakPolarHBondContact O-CB 3.43Å; L34-S38 PolarHBondContact O-N 3.03Å; A35-S38 WeakPolarHBondContact O-CB 3.36Å; A35-S38 PolarHBondContact O-N 3.3Å; L36-S38 VanDerWaalsContact C-N 3.29Å; L36-S38 PolarHBondContact O-N 3.47Å; S38-I40 VanDerWaalsContact C-N 3.35Å; S38-I40 PolarHBondContact O-N 3.41Å; S38-S41 PolarHBondContact O-N 3.49Å; S38-S42 WeakPolarHBondContact O-CB 3.48Å; S38-S42 PolarHBondContact O-N 2.96Å; S38-S42 PolarHBondContact O-OG 3.1Å |
| 39 | M | 95.2 | Very high | 86.6 | Confident | 114 Ų | 114 | 102.2 Ų | 102.2 | 56% | 0.562 | 53% | 0.528 | S | S | * | . | H | α-helix | trans | -61.5 | -41.9 | 179.5 | -71.9 | -174 | -64.6 | 0 | 0 | 112.3 | A35 L36 R43 | A35-M39 WeakPolarHBondContact O-CG 3.43Å; A35-M39 PolarHBondContact O-N 3.39Å; L36-M39 HydrophobicContact CB-CE 4.47Å; L36-M39 HydrophobicContact CD2-CE 3.55Å; L36-M39 HydrophobicContact CG-CE 4.17Å; L36-M39 PolarHBondContact O-N 3.15Å; M39-R43 WeakPolarHBondContact O-CB 3.35Å; M39-R43 PolarHBondContact O-N 2.96Å |
| 40 | I | 94.2 | Very high | 84.4 | Confident | 110 Ų | 110 | 101.1 Ų | 101.1 | 56% | 0.564 | 53% | 0.53 | S | S | * | . | H | α-helix | trans | -65.3 | -43 | 176.8 | -66.4 | 165.9 | 0 | 0 | 0 | 110.6 | L36 Q37 S38 R43 R44 | L36-I40 WeakPolarHBondContact O-CG1 3.26Å; L36-I40 PolarHBondContact O-N 2.96Å; Q37-I40 PolarHBondContact O-N 3.01Å; S38-I40 VanDerWaalsContact C-N 3.35Å; S38-I40 PolarHBondContact O-N 3.41Å; I40-R43 PolarHBondContact O-N 3.3Å; I40-R44 WeakPolarHBondContact O-CB 3.49Å; I40-R44 PolarHBondContact O-N 3.38Å |
| 41 | S | 93.2 | Very high | 82.2 | Confident | 71 Ų | 71 | 98.8 Ų | 98.8 | 50% | 0.497 | 53% | 0.53 | S | S | . | . | H | α-helix | trans | -67.2 | -41.4 | 179.9 | -56.2 | 0 | 0 | 0 | 0 | 111.6 | Q37 S38 R44 G45 | Q37-S41 VanDerWaalsContact O-CB 3.32Å; Q37-S41 WeakPolarHBondContact O-CB 3.42Å; Q37-S41 PolarHBondContact O-N 3.47Å; Q37-S41 PolarHBondContact O-OG 2.93Å; S38-S41 PolarHBondContact O-N 3.49Å; S41-R44 PolarHBondContact O-N 3.22Å; S41-G45 PolarHBondContact O-N 3.37Å; S41-G45 VanDerWaalsContact O-N 3.15Å |
| 42 | S | 89.7 | Confident | 79.9 | Confident | 77 Ų | 77 | 101.1 Ų | 101.1 | 54% | 0.538 | 53% | 0.534 | S | S | . | . | H | α-helix | trans | -60.8 | -45.8 | 174.1 | -65.9 | 0 | 0 | 0 | 0 | 111.3 | S38 R44 G45 D46 | S38-S42 WeakPolarHBondContact O-CB 3.48Å; S38-S42 PolarHBondContact O-N 2.96Å; S38-S42 PolarHBondContact O-OG 3.1Å; S42-R44 PolarHBondContact O-N 3.32Å; S42-G45 PolarHBondContact O-N 3.37Å; S42-D46 PolarHBondContact O-N 3.47Å |
| 43 | R | 86.8 | Confident | 77 | Confident | 166 Ų | 166 | 102.4 Ų | 102.4 | 63% | 0.626 | 55% | 0.547 | S | S | * | . | H | α-helix | trans | -64.2 | -40.2 | 179 | -174.4 | 174.2 | 173.9 | -140.2 | -15 | 112.7 | M39 I40 G45 D46 E47 | M39-R43 WeakPolarHBondContact O-CB 3.35Å; M39-R43 PolarHBondContact O-N 2.96Å; I40-R43 PolarHBondContact O-N 3.3Å; R43-G45 VanDerWaalsContact C-N 3.31Å; R43-G45 PolarHBondContact O-N 3.45Å; R43-D46 PolarHBondContact O-N 2.9Å; R43-E47 IonicContact CZ-OE1 3.38Å; R43-E47 IonicContact NE-OE1 3.35Å; R43-E47 PolarHBondContact NE-OE1 3.18Å; R43-E47 IonicContact NH2-OE1 2.79Å; R43-E47 PolarHBondContact NH2-OE1 3.5Å; R43-E47 PolarHBondContact O-N 2.96Å |
| 44 | R | 79.5 | Confident | 74.2 | Confident | 183 Ų | 183 | 102.4 Ų | 102.4 | 69% | 0.691 | 55% | 0.554 | S | S | * | * | H | α-helix | trans | -64.3 | -35.8 | 177.3 | -173.5 | 178.9 | -72.1 | -111 | -0.7 | 112.2 | I40 S41 S42 M48 | I40-R44 WeakPolarHBondContact O-CB 3.49Å; I40-R44 PolarHBondContact O-N 3.38Å; S41-R44 PolarHBondContact O-N 3.22Å; S42-R44 PolarHBondContact O-N 3.32Å; R44-M48 PolarHBondContact O-N 3.02Å |
| 45 | G | 68.2 | Low | 71.6 | Confident | 34 Ų | 34 | 103.7 Ų | 103.7 | 35% | 0.351 | 57% | 0.568 | S | S | . | * | H | α-helix | trans | -66.8 | -39.3 | 172.2 | 0 | 0 | 0 | 0 | 0 | 112.5 | S41 S42 R43 M48 L49 | S41-G45 PolarHBondContact O-N 3.37Å; S41-G45 VanDerWaalsContact O-N 3.15Å; S42-G45 PolarHBondContact O-N 3.37Å; R43-G45 VanDerWaalsContact C-N 3.31Å; R43-G45 PolarHBondContact O-N 3.45Å; G45-M48 PolarHBondContact O-N 3.15Å; G45-L49 WeakPolarHBondContact O-CG 3.38Å; G45-L49 PolarHBondContact O-N 2.99Å |
| 46 | D | 62.7 | Low | 69.1 | Low | 111 Ų | 111 | 110.6 Ų | 110.6 | 59% | 0.594 | 59% | 0.591 | S | S | * | * | H | α-helix | trans | -71.8 | -34.7 | -179 | -140.2 | 18.3 | 0 | 0 | 0 | 112.7 | S42 R43 M48 L49 S50 | S42-D46 PolarHBondContact O-N 3.47Å; R43-D46 PolarHBondContact O-N 2.9Å; D46-M48 VanDerWaalsContact C-N 3.32Å; D46-M48 PolarHBondContact O-N 3.26Å; D46-L49 PolarHBondContact O-N 3.34Å; D46-S50 WeakPolarHBondContact O-CB 3.42Å; D46-S50 PolarHBondContact O-N 2.86Å |
| 47 | E | 59.8 | Low | 66.5 | Low | 110 Ų | 110 | 115.2 Ų | 115.2 | 51% | 0.514 | 61% | 0.61 | S | S | . | * | H | α-helix | trans | -63.9 | -36.6 | 171.9 | -91.5 | 160 | -172.5 | 0 | 0 | 112 | R43 S51 | R43-E47 IonicContact CZ-OE1 3.38Å; R43-E47 IonicContact NE-OE1 3.35Å; R43-E47 PolarHBondContact NE-OE1 3.18Å; R43-E47 IonicContact NH2-OE1 2.79Å; R43-E47 PolarHBondContact NH2-OE1 3.5Å; R43-E47 PolarHBondContact O-N 2.96Å; E47-S51 PolarHBondContact O-N 2.97Å |
| 48 | M | 57.7 | Low | 64.1 | Low | 133 Ų | 133 | 114.8 Ų | 114.8 | 66% | 0.655 | 62% | 0.619 | S | S | * | * | H | α-helix | trans | -67.1 | -41.4 | 172.3 | -74.1 | -175.2 | 141.1 | 0 | 0 | 111.8 | R44 G45 D46 S51 H52 | R44-M48 PolarHBondContact O-N 3.02Å; G45-M48 PolarHBondContact O-N 3.15Å; D46-M48 VanDerWaalsContact C-N 3.32Å; D46-M48 PolarHBondContact O-N 3.26Å; M48-S51 PolarHBondContact O-OG 2.68Å; M48-H52 PolarHBondContact O-CD2 3.45Å |
| 49 | L | 53.3 | Low | 61.9 | Low | 111 Ų | 111 | 119.7 Ų | 119.7 | 58% | 0.581 | 63% | 0.634 | S | S | * | * | H | α-helix | trans | -77.7 | -36.4 | -178.3 | -65.5 | 175.5 | 0 | 0 | 0 | 113.4 | G45 D46 S51 H52 T53 | G45-L49 WeakPolarHBondContact O-CG 3.38Å; G45-L49 PolarHBondContact O-N 2.99Å; D46-L49 PolarHBondContact O-N 3.34Å; L49-S51 PolarHBondContact O-N 3.25Å; L49-H52 WeakPolarHBondContact O-CA 3.47Å; L49-H52 PolarHBondContact O-N 3.41Å; L49-T53 PolarHBondContact O-N 2.91Å |
| 50 | S | 53 | Low | 59.8 | Low | 84 Ų | 84 | 122 Ų | 122 | 59% | 0.587 | 65% | 0.649 | S | S | * | * | H | α-helix | trans | -66.4 | -26.2 | 176.4 | -173.6 | 0 | 0 | 0 | 0 | 111.9 | D46 H52 | D46-S50 WeakPolarHBondContact O-CB 3.42Å; D46-S50 PolarHBondContact O-N 2.86Å; S50-H52 PolarHBondContact O-N 3.22Å |
| 51 | S | 50.8 | Low | 57.8 | Low | 80 Ų | 80 | 125 Ų | 125 | 56% | 0.559 | 66% | 0.662 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.1 | -11.2 | 169.3 | 71.9 | 0 | 0 | 0 | 0 | 113.9 | E47 M48 L49 | E47-S51 PolarHBondContact O-N 2.97Å; M48-S51 PolarHBondContact O-OG 2.68Å; L49-S51 PolarHBondContact O-N 3.25Å |
| 52 | H | 50.9 | Low | 56 | Low | 148 Ų | 148 | 127.9 Ų | 127.9 | 69% | 0.685 | 67% | 0.672 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -113.3 | -4.1 | -174.6 | -66.3 | -41 | 0 | 0 | 0 | 114.9 | M48 L49 S50 | M48-H52 PolarHBondContact O-CD2 3.45Å; L49-H52 WeakPolarHBondContact O-CA 3.47Å; L49-H52 PolarHBondContact O-N 3.41Å; S50-H52 PolarHBondContact O-N 3.22Å |
| 53 | T | 37.7 | Very low | 54.7 | Low | 104 Ų | 104 | 129.1 Ų | 129.1 | 64% | 0.638 | 68% | 0.676 | S | S | * | * | trans | -125.8 | 71.3 | -178.6 | 65.1 | 0 | 0 | 0 | 0 | 112.7 | L49 | L49-T53 PolarHBondContact O-N 2.91Š| ||
| 54 | V | 39.2 | Very low | 53.6 | Low | 107 Ų | 107 | 127 Ų | 127 | 65% | 0.648 | 67% | 0.672 | S | S | * | * | S | Bend | trans | -134.4 | 122.2 | 149.8 | -174.9 | 0 | 0 | 0 | 0 | 107.1 | ||
| 55 | P | 43.4 | Very low | 53.2 | Low | 114 Ų | 114 | 124.2 Ų | 124.2 | 74% | 0.74 | 68% | 0.676 | S | S | * | * | trans | -67.4 | 145.6 | -166.4 | 28.9 | -34.2 | 0 | 0 | 0 | 111 | Q57 | P55-Q57 PolarHBondContact O-N 2.83Š| ||
| 56 | E | 44.6 | Very low | 53.5 | Low | 193 Ų | 193 | 129.3 Ų | 129.3 | 90% | 0.902 | 70% | 0.695 | S | S | * | * | S | Bend | trans | -36.5 | 92.9 | 172.5 | -65.1 | 177.7 | 124.9 | 0 | 0 | 113.2 | ||
| 57 | Q | 44.5 | Very low | 54.3 | Low | 196 Ų | 196 | 127 Ų | 127 | 92% | 0.916 | 68% | 0.683 | S | S | * | * | S | Bend | trans | -174.7 | 7.7 | 144.4 | -114.7 | 175.2 | 22.4 | 0 | 0 | 117 | P55 | P55-Q57 PolarHBondContact O-N 2.83Š|
| 58 | S | 46.5 | Very low | 55.3 | Low | 96 Ų | 96 | 129 Ų | 129 | 67% | 0.671 | 69% | 0.692 | S | S | * | * | trans | -140.1 | 50.6 | 172.9 | 49.7 | 0 | 0 | 0 | 0 | 111.6 | D60 | S58-D60 VanDerWaalsContact C-N 3.33Å; S58-D60 PolarHBondContact O-N 3.45Å | ||
| 59 | H | 49.6 | Very low | 56.5 | Low | 171 Ų | 171 | 125 Ų | 125 | 79% | 0.792 | 68% | 0.68 | S | S | * | * | G | 310 helix | trans | -81.4 | -3.3 | -174.6 | -160.9 | 58.8 | 0 | 0 | 0 | 114.6 | M61 | H59-M61 PolarHBondContact O-N 3.37Š|
| 60 | D | 50 | Low | 57.7 | Low | 163 Ų | 163 | 121.6 Ų | 121.6 | 87% | 0.872 | 67% | 0.666 | S | S | * | * | G | 310 helix | trans | -83.7 | -3.1 | -173.6 | -105.2 | -4.6 | 0 | 0 | 0 | 115.5 | S58 | S58-D60 VanDerWaalsContact C-N 3.33Å; S58-D60 PolarHBondContact O-N 3.45Å |
| 61 | M | 52.9 | Low | 59 | Low | 173 Ų | 173 | 122 Ų | 122 | 85% | 0.852 | 66% | 0.66 | S | S | * | * | G | 310 helix | trans | -128.2 | 8.2 | -175.8 | -75.9 | -173.4 | -83.3 | 0 | 0 | 115.4 | H59 V63 | H59-M61 PolarHBondContact O-N 3.37Å; M61-V63 PolarHBondContact O-N 2.95Å |
| 62 | L | 55.5 | Low | 60.5 | Low | 132 Ų | 132 | 124 Ų | 124 | 69% | 0.691 | 66% | 0.664 | S | S | * | * | trans | -85.9 | 57 | 173.5 | -141.2 | 134.1 | 0 | 0 | 0 | 109.9 | H64 | L62-H64 PolarHBondContact O-N 3.44Š| ||
| 63 | V | 61.8 | Low | 62.1 | Low | 103 Ų | 103 | 124 Ų | 124 | 62% | 0.624 | 67% | 0.665 | S | S | * | * | trans | -62.9 | 104.8 | 174.4 | -175.9 | 0 | 0 | 0 | 0 | 106.7 | M61 V65 | M61-V63 PolarHBondContact O-N 2.95Å; V63-V65 PolarHBondContact O-N 2.92Å | ||
| 64 | H | 64.1 | Low | 64 | Low | 120 Ų | 120 | 124.6 Ų | 124.6 | 56% | 0.556 | 67% | 0.668 | S | S | * | * | trans | -56.5 | 102.2 | 176.3 | -174.7 | -69.8 | 0 | 0 | 0 | 108.9 | L62 D66 N67 | L62-H64 PolarHBondContact O-N 3.44Å; H64-D66 PolarHBondContact CE1-O 2.65Å; H64-D66 VanDerWaalsContact ND1-C 3.28Å; H64-D66 PolarHBondContact O-N 3.12Å; H64-N67 HydrophobicContact CB-CB 4.05Å; H64-N67 WeakPolarHBondContact ND1-CB 3.39Å; H64-N67 PolarHBondContact ND1-N 2.89Å; H64-N67 WeakPolarHBondContact O-CB 3.35Å; H64-N67 PolarHBondContact O-N 3.37Å; H64-N67 VanDerWaalsContact O-N 3.16Å | ||
| 65 | V | 71.8 | Confident | 66.2 | Low | 125 Ų | 125 | 125.4 Ų | 125.4 | 76% | 0.758 | 67% | 0.674 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -62 | -30.7 | -169.8 | -114.9 | 0 | 0 | 0 | 0 | 112.5 | V63 | V63-V65 PolarHBondContact O-N 2.92Š|
| 66 | D | 73.6 | Confident | 68.2 | Low | 141 Ų | 141 | 126.8 Ų | 126.8 | 75% | 0.754 | 68% | 0.675 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -103.1 | 30.2 | 180 | -67.3 | -26 | 0 | 0 | 0 | 112.7 | H64 | H64-D66 PolarHBondContact CE1-O 2.65Å; H64-D66 VanDerWaalsContact ND1-C 3.28Å; H64-D66 PolarHBondContact O-N 3.12Å |
| 67 | N | 80.6 | Confident | 70.2 | Confident | 63 Ų | 63 | 126 Ų | 126 | 34% | 0.337 | 67% | 0.671 | S | S | . | * | trans | -89.6 | 112.8 | 174.1 | -175.4 | 42.8 | 0 | 0 | 0 | 109.2 | H64 A69 S70 I71 | H64-N67 HydrophobicContact CB-CB 4.05Å; H64-N67 WeakPolarHBondContact ND1-CB 3.39Å; H64-N67 PolarHBondContact ND1-N 2.89Å; H64-N67 WeakPolarHBondContact O-CB 3.35Å; H64-N67 PolarHBondContact O-N 3.37Å; H64-N67 VanDerWaalsContact O-N 3.16Å; N67-A69 PolarHBondContact O-N 3.09Å; N67-S70 WeakPolarHBondContact CB-OG 3.32Å; N67-S70 PolarHBondContact ND2-N 3.15Å; N67-S70 PolarHBondContact ND2-OG 3.39Å; N67-S70 WeakPolarHBondContact O-CB 3.43Å; N67-S70 PolarHBondContact O-N 3.29Å; N67-I71 PolarHBondContact O-N 3.1Å; N67-I71 VanDerWaalsContact O-N 3.07Å | ||
| 68 | E | 79.8 | Confident | 72 | Confident | 151 Ų | 151 | 123.2 Ų | 123.2 | 71% | 0.706 | 66% | 0.662 | S | S | * | * | H | α-helix | trans | -51.4 | -41.8 | 179.3 | -175.5 | 179.9 | -178.8 | 0 | 0 | 111.8 | S70 I71 N72 | E68-S70 PolarHBondContact O-N 3.38Å; E68-I71 PolarHBondContact O-N 3.34Å; E68-N72 PolarHBondContact O-N 2.86Å; E68-N72 PolarHBondContact O-ND2 3.44Å |
| 69 | A | 82.4 | Confident | 73.5 | Confident | 50 Ų | 50 | 124.3 Ų | 124.3 | 41% | 0.413 | 67% | 0.669 | S | S | . | * | H | α-helix | trans | -66.5 | -34 | 178.2 | 0 | 0 | 0 | 0 | 0 | 113.1 | N67 Q73 | N67-A69 PolarHBondContact O-N 3.09Å; A69-Q73 VanDerWaalsContact O-CG 3.3Å; A69-Q73 WeakPolarHBondContact O-CG 3.43Å; A69-Q73 PolarHBondContact O-N 3.36Å |
| 70 | S | 79.7 | Confident | 74.7 | Confident | 40 Ų | 40 | 122.7 Ų | 122.7 | 28% | 0.28 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -72.2 | -38.6 | 177.6 | -60 | 0 | 0 | 0 | 0 | 111.8 | N67 E68 N72 Q73 | N67-S70 WeakPolarHBondContact CB-OG 3.32Å; N67-S70 PolarHBondContact ND2-N 3.15Å; N67-S70 PolarHBondContact ND2-OG 3.39Å; N67-S70 WeakPolarHBondContact O-CB 3.43Å; N67-S70 PolarHBondContact O-N 3.29Å; E68-S70 PolarHBondContact O-N 3.38Å; S70-N72 VanDerWaalsContact C-N 3.32Å; S70-N72 PolarHBondContact O-N 3Å; S70-Q73 PolarHBondContact O-N 2.9Å |
| 71 | I | 79.4 | Confident | 75.7 | Confident | 92 Ų | 92 | 124.3 Ų | 124.3 | 47% | 0.472 | 67% | 0.671 | S | S | . | * | H | α-helix | trans | -61.6 | -44 | 177.4 | -66 | 169.3 | 0 | 0 | 0 | 110.1 | N67 E68 Q73 T74 | N67-I71 PolarHBondContact O-N 3.1Å; N67-I71 VanDerWaalsContact O-N 3.07Å; E68-I71 PolarHBondContact O-N 3.34Å; I71-Q73 PolarHBondContact O-N 3.03Å; I71-T74 PolarHBondContact O-N 3.14Å; I71-T74 PolarHBondContact O-OG1 3.44Å |
| 72 | N | 83.5 | Confident | 75.9 | Confident | 121 Ų | 121 | 120.4 Ų | 120.4 | 65% | 0.647 | 66% | 0.66 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -71.5 | -14.2 | -178.5 | -70.3 | -26.9 | 0 | 0 | 0 | 114.4 | E68 S70 | E68-N72 PolarHBondContact O-N 2.86Å; E68-N72 PolarHBondContact O-ND2 3.44Å; S70-N72 VanDerWaalsContact C-N 3.32Å; S70-N72 PolarHBondContact O-N 3Å |
| 73 | Q | 82.7 | Confident | 75.9 | Confident | 149 Ų | 149 | 119.2 Ų | 119.2 | 70% | 0.696 | 65% | 0.651 | S | S | * | * | T | Hydrogen-bonded Turn | trans | -89.2 | -1.6 | 177.3 | -73.2 | 176.2 | 16.8 | 0 | 0 | 113.3 | A69 S70 I71 T75 | A69-Q73 VanDerWaalsContact O-CG 3.3Å; A69-Q73 WeakPolarHBondContact O-CG 3.43Å; A69-Q73 PolarHBondContact O-N 3.36Å; S70-Q73 PolarHBondContact O-N 2.9Å; I71-Q73 PolarHBondContact O-N 3.03Å; Q73-T75 PolarHBondContact O-N 2.99Å; Q73-T75 VanDerWaalsContact O-N 3.09Å |
| 74 | T | 79.6 | Confident | 75.6 | Confident | 116 Ų | 116 | 120 Ų | 120 | 71% | 0.712 | 66% | 0.655 | S | S | * | * | trans | -66 | 111.8 | 178.1 | 54.1 | 0 | 0 | 0 | 0 | 110.5 | I71 | I71-T74 PolarHBondContact O-N 3.14Å; I71-T74 PolarHBondContact O-OG1 3.44Å | ||
| 75 | T | 84.2 | Confident | 75.1 | Confident | 125 Ų | 125 | 120.8 Ų | 120.8 | 77% | 0.767 | 67% | 0.669 | S | S | * | * | trans | -91.5 | 120.9 | 177.8 | -58.1 | 0 | 0 | 0 | 0 | 108.7 | Q73 E77 | Q73-T75 PolarHBondContact O-N 2.99Å; Q73-T75 VanDerWaalsContact O-N 3.09Å; T75-E77 PolarHBondContact O-N 3.12Å | ||
| 76 | L | 85.7 | Confident | 74.1 | Confident | 143 Ų | 143 | 122.2 Ų | 122.2 | 75% | 0.749 | 67% | 0.667 | S | S | * | * | trans | -84.3 | 112 | -179.5 | -172.2 | 70.4 | 0 | 0 | 0 | 110.2 | L78 | L76-L78 HydrophobicContact CD1-CD2 4.32Å; L76-L78 HydrophobicContact CD2-CD1 3.93Å; L76-L78 HydrophobicContact CD2-CD2 3.96Å; L76-L78 HydrophobicContact CD2-CG 3.92Å; L76-L78 HydrophobicContact CG-CD1 4.49Å; L76-L78 HydrophobicContact CG-CD2 3.93Å; L76-L78 HydrophobicContact CG-CG 3.95Å | ||
| 77 | E | 86.8 | Confident | 73.1 | Confident | 176 Ų | 176 | 123.9 Ų | 123.9 | 82% | 0.822 | 67% | 0.671 | S | S | * | * | trans | -91.4 | 102 | 174.2 | -66.5 | -176.5 | -175.1 | 0 | 0 | 110.2 | T75 | T75-E77 PolarHBondContact O-N 3.12Š| ||
| 78 | L | 81.4 | Confident | 71.7 | Confident | 138 Ų | 138 | 129.9 Ų | 129.9 | 72% | 0.723 | 70% | 0.697 | S | S | * | * | trans | -99.2 | 107.6 | 173.8 | -61 | 178.9 | 0 | 0 | 0 | 109.2 | L76 | L76-L78 HydrophobicContact CD1-CD2 4.32Å; L76-L78 HydrophobicContact CD2-CD1 3.93Å; L76-L78 HydrophobicContact CD2-CD2 3.96Å; L76-L78 HydrophobicContact CD2-CG 3.92Å; L76-L78 HydrophobicContact CG-CD1 4.49Å; L76-L78 HydrophobicContact CG-CD2 3.93Å; L76-L78 HydrophobicContact CG-CG 3.95Å | ||
| 79 | S | 79.3 | Confident | 70.1 | Confident | 118 Ų | 118 | 131.7 Ų | 131.7 | 83% | 0.825 | 71% | 0.705 | S | S | * | * | trans | -84.6 | 115.1 | 169 | -71.2 | 0 | 0 | 0 | 0 | 109.4 | K81 | S79-K81 PolarHBondContact O-N 3.45Å; S79-K81 VanDerWaalsContact O-N 3.12Å | ||
| 80 | T | 74 | Confident | 68.4 | Low | 137 Ų | 137 | 138.5 Ų | 138.5 | 84% | 0.84 | 73% | 0.728 | S | S | * | * | trans | -76.1 | 95.5 | 164.2 | 47.7 | 0 | 0 | 0 | 0 | 107.5 | S82 | T80-S82 PolarHBondContact O-N 3.16Š| ||
| 81 | K | 70.7 | Confident | 66.9 | Low | 198 Ų | 198 | 145.8 Ų | 145.8 | 86% | 0.861 | 76% | 0.758 | S | S | * | * | trans | -61.4 | 109.8 | 164.8 | -168.2 | 173.2 | 179.2 | -173.6 | 0 | 105.4 | S79 H83 | S79-K81 PolarHBondContact O-N 3.45Å; S79-K81 VanDerWaalsContact O-N 3.12Å; K81-H83 VanDerWaalsContact C-N 3.35Å; K81-H83 PolarHBondContact O-N 3.31Å | ||
| 82 | S | 57.4 | Low | 65.5 | Low | 90 Ų | 90 | 150.1 Ų | 150.1 | 63% | 0.629 | 78% | 0.776 | S | S | * | * | trans | -57.3 | 102.5 | 176.8 | 58.9 | 0 | 0 | 0 | 0 | 107.2 | T80 V84 | T80-S82 PolarHBondContact O-N 3.16Å; S82-V84 PolarHBondContact O-N 3.2Å | ||
| 83 | H | 55.7 | Low | 63.8 | Low | 108 Ų | 108 | 153.5 Ų | 153.5 | 50% | 0.5 | 79% | 0.788 | S | S | . | * | trans | -67.1 | 71.8 | 171.1 | 178.4 | -55.3 | 0 | 0 | 0 | 107.6 | K81 E86 | K81-H83 VanDerWaalsContact C-N 3.35Å; K81-H83 PolarHBondContact O-N 3.31Å; H83-E86 IonicContact CD2-OE2 3.71Å; H83-E86 VanDerWaalsContact CE1-C 3.49Å; H83-E86 WeakPolarHBondContact CE1-CB 3.47Å; H83-E86 VanDerWaalsContact NE2-CB 3.27Å; H83-E86 WeakPolarHBondContact NE2-CB 3.47Å; H83-E86 IonicContact NE2-OE2 3.64Å | ||
| 84 | V | 55.9 | Low | 62.1 | Low | 118 Ų | 118 | 155.5 Ų | 155.5 | 72% | 0.715 | 80% | 0.798 | S | S | * | * | trans | -105.2 | 27.7 | 176.5 | -178.9 | 0 | 0 | 0 | 0 | 108.8 | S82 | S82-V84 PolarHBondContact O-N 3.2Š| ||
| 85 | T | 52.9 | Low | 60.5 | Low | 137 Ų | 137 | 159 Ų | 159 | 84% | 0.84 | 81% | 0.806 | S | S | * | * | S | Bend | trans | -156.7 | 18.2 | -180 | 3 | 0 | 0 | 0 | 0 | 115.7 | ||
| 86 | E | 51.7 | Low | 58.7 | Low | 156 Ų | 156 | 159.2 Ų | 159.2 | 73% | 0.729 | 81% | 0.813 | S | S | * | * | S | Bend | trans | -118.8 | 0.9 | 171.6 | -98.9 | 169.7 | -172.9 | 0 | 0 | 112.8 | H83 | H83-E86 IonicContact CD2-OE2 3.71Å; H83-E86 VanDerWaalsContact CE1-C 3.49Å; H83-E86 WeakPolarHBondContact CE1-CB 3.47Å; H83-E86 VanDerWaalsContact NE2-CB 3.27Å; H83-E86 WeakPolarHBondContact NE2-CB 3.47Å; H83-E86 IonicContact NE2-OE2 3.64Å |
| 87 | E | 51.8 | Low | 57.1 | Low | 175 Ų | 175 | 160 Ų | 160 | 82% | 0.818 | 82% | 0.818 | S | S | * | * | S | Bend | trans | -92.2 | 9.4 | 176.1 | -70.5 | -155.4 | 162.2 | 0 | 0 | 114.8 | ||
| 88 | E | 50.5 | Low | 55.6 | Low | 190 Ų | 190 | 160.9 Ų | 160.9 | 89% | 0.888 | 84% | 0.843 | S | S | * | * | S | Bend | trans | -116 | 0 | 179.9 | -73.1 | -164.4 | 167.8 | 0 | 0 | 116.1 | ||
| 89 | E | 46.6 | Very low | 54.3 | Low | 189 Ų | 189 | 162 Ų | 162 | 88% | 0.883 | 85% | 0.849 | S | S | * | * | S | Bend | trans | -124.2 | 3.1 | -176.3 | -73.8 | -164.3 | 168.7 | 0 | 0 | 117.8 | ||
| 90 | E | 46.2 | Very low | 53 | Low | 193 Ų | 193 | 164.3 Ų | 164.3 | 90% | 0.902 | 85% | 0.85 | S | S | * | * | S | Bend | trans | -121.8 | 18.3 | 175.1 | -72.1 | -166.6 | -177.4 | 0 | 0 | 115.4 | E92 | E90-E92 VanDerWaalsContact C-N 3.3Å; E90-E92 PolarHBondContact O-N 3.13Å |
| 91 | E | 49.7 | Very low | 51.8 | Low | 192 Ų | 192 | 165.8 Ų | 165.8 | 90% | 0.897 | 85% | 0.851 | S | S | * | * | S | Bend | trans | -91 | 46.8 | 160 | -74.4 | -162.8 | 172.9 | 0 | 0 | 111.5 | ||
| 92 | E | 50.2 | Low | 50.7 | Low | 184 Ų | 184 | 163.9 Ų | 163.9 | 86% | 0.86 | 85% | 0.85 | S | S | * | * | S | Bend | trans | -143.1 | 22.6 | 172.3 | -83.1 | -153.6 | 179.3 | 0 | 0 | 115.9 | E90 | E90-E92 VanDerWaalsContact C-N 3.3Å; E90-E92 PolarHBondContact O-N 3.13Å |
| 93 | E | 46.8 | Very low | 50.3 | Low | 192 Ų | 192 | 168.6 Ų | 168.6 | 90% | 0.897 | 86% | 0.864 | S | S | * | * | trans | -143.5 | 50.9 | 166.1 | -71.7 | -158.1 | -163.8 | 0 | 0 | 114.3 | ||||
| 94 | E | 46.3 | Very low | 49.9 | Very low | 191 Ų | 191 | 172.6 Ų | 172.6 | 89% | 0.893 | 89% | 0.888 | S | S | * | * | trans | -110.4 | 64.9 | 162.6 | -77.3 | -78.5 | -178.4 | 0 | 0 | 109.5 | ||||
| 95 | E | 46.9 | Very low | 49.5 | Very low | 189 Ų | 189 | 176.5 Ų | 176.5 | 88% | 0.883 | 90% | 0.9 | S | S | * | * | trans | -164.2 | 74 | 162 | -120.5 | -174.3 | -158.2 | 0 | 0 | 112.4 | ||||
| 96 | S | 47.3 | Very low | 49.2 | Very low | 130 Ų | 130 | 179.5 Ų | 179.5 | 91% | 0.909 | 91% | 0.905 | S | S | * | * | trans | -162.2 | 88.6 | 151 | -89.8 | 0 | 0 | 0 | 0 | 113 | ||||
| 97 | D | 52 | Low | 49 | Very low | 160 Ų | 160 | 181.5 Ų | 181.5 | 86% | 0.856 | 92% | 0.92 | S | S | * | * | trans | -43.5 | 126.7 | 163 | -169 | 19.8 | 0 | 0 | 0 | 115.1 | ||||
| 98 | S | 53.7 | Low | 48.8 | Very low | 193 Ų | 193 | 182.1 Ų | 182.1 | 100% | 1.35 | 93% | 0.929 | S | S | * | * | trans | -167.2 | 0 | 155.4 | -77.5 | 0 | 0 | 0 | 0 | 112.7 |
Retrieved 98 of 98 residues in 249.2 ms
(Link to these results)